|
Marialite |
 |
Papike J J, Zoltai T |
 |
American Mineralogist 50 (1965) 641-655 |
|
The crystal structure of a marialite scapolite |
|
_database_code_amcsd 0000134 |
|
12.060 12.060 7.572 90 90 90 I4/m |
|
atom x y z occ Biso |
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Na .1340 .2113 0 .79 2.65 |
|
Ca .1340 .2113 0 .19 2.65 |
|
K .1340 .2113 0 .02 2.65 |
|
Si1 .3388 .4104 0 .82 |
|
Si2 .3374 .0851 .2060 .55 .76 |
|
Al2 .3374 .0851 .2060 .46 .76 |
|
O1 .4587 .3483 0 1.60 |
|
O2 .3066 .1206 0 2.14 |
|
O3 .0517 .3500 .2148 1.55 |
|
O4 .2293 .1289 .3281 1.37 |
|
Cl 0 0 0 .95 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Sokolova E V, Kabalov Y K, Sherriff B L, Teertstra D K |
|
Jenkins D M, Kunath-Fandrei G, Goetz S, Jager C |
|
The Canadian Mineralogist 34 (1996) 1039-1050 |
|
Marialite: Rietveld structure-refinement and Si MAS |
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and Al satellite transition NMR spectroscopy |
|
Sample: syn-mar |
|
_database_code_amcsd 0005510 |
|
12.0396 12.0396 7.5427 90 90 90 I4/m |
|
atom x y z occ Biso |
|
NaM .3741 .2997 .5 4.5 |
|
SiT1 .3386 .4107 0 .75 1.05 |
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AlT1 .3386 .4107 0 .25 1.05 |
|
SiT2 .6611 .9154 .7936 .75 1.45 |
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AlT2 .6611 .9154 .7936 .25 1.45 |
|
O1 .4564 .3522 0 1.5 |
|
O2 .6909 .8823 0 1.5 |
|
O3 .3538 .9488 .7845 2.0 |
|
O4 .2691 .3729 .8250 2.0 |
|
Cl .5 .5 .5 .98 3.8 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Sokolova E V, Kabalov Y K, Sherriff B L, Teertstra D K |
|
Jenkins D M, Kunath-Fandrei G, Goetz S, Jager C |
|
The Canadian Mineralogist 34 (1996) 1039-1050 |
|
Marialite: Rietveld structure-refinement and Si MAS |
|
and Al satellite transition NMR spectroscopy |
|
Sample: PAM-1 |
|
_database_code_amcsd 0005511 |
|
12.047 12.047 7.5602 90 90 90 I4/m |
|
atom x y z occ Biso |
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NaM .3751 .2981 .5 .88 3.63 |
|
KM .3751 .2981 .5 .07 3.63 |
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CaM .3751 .2981 .5 .05 3.63 |
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SiT1 .3373 .4109 0 .74 .71 |
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AlT1 .3373 .4109 0 .26 .71 |
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SiT2 .6611 .9151 .7939 .74 .53 |
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AlT2 .6611 .9151 .7939 .26 .53 |
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O1 .4533 .3524 0 1.8 |
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O2 .6941 .8801 0 1.7 |
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O3 .3518 .9485 .7892 1.4 |
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O4 .2718 .3726 .8216 1.5 |
|
Cl .5 .5 .5 4.7 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Sokolova E V, Kabalov Y K, Sherriff B L, Teertstra D K |
|
Jenkins D M, Kunath-Fandrei G, Goetz S, Jager C |
|
The Canadian Mineralogist 34 (1996) 1039-1050 |
|
Marialite: Rietveld structure-refinement and Si MAS |
|
and Al satellite transition NMR spectroscopy |
|
Sample: PAM-2 |
|
_database_code_amcsd 0005512 |
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12.0489 12.0489 7.5665 90 90 90 I4/m |
|
atom x y z occ Biso |
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NaM .3725 .300 .5 .86 4.4 |
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KM .3725 .300 .5 .07 4.4 |
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CaM .3725 .300 .5 .07 4.4 |
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SiT1 .3408 .4114 0 .73 1.8 |
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AlT1 .3408 .4114 0 .27 1.8 |
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SiT2 .6621 .9140 .7936 .73 1.2 |
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AlT2 .6621 .9140 .7936 .27 1.2 |
|
O1 .457 .354 0 2.5 |
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O2 .694 .882 0 1.4 |
|
O3 .3493 .9501 .784 2.4 |
|
O4 .2704 .3741 .826 2.4 |
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Cl .5 .5 .5 .95 7.2 |
|
OH .5 .5 .5 .05 7.2 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Sokolova E V, Kabalov Y K, Sherriff B L, Teertstra D K |
|
Jenkins D M, Kunath-Fandrei G, Goetz S, Jager C |
|
The Canadian Mineralogist 34 (1996) 1039-1050 |
|
Marialite: Rietveld structure-refinement and Si MAS |
|
and Al satellite transition NMR spectroscopy |
|
Sample: PAM-3 |
|
_database_code_amcsd 0005513 |
|
12.0546 12.0546 7.5684 90 90 90 I4/m |
|
atom x y z occ Biso |
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NaM .3729 .296 .5 .88 3.5 |
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KM .3729 .296 .5 .04 3.5 |
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CaM .3729 .296 .5 .07 3.5 |
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SiT1 .3372 .4117 0 .73 .9 |
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AlT1 .3372 .4117 0 .27 .9 |
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SiT2 .6611 .9147 .7933 .73 .74 |
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AlT2 .6611 .9147 .7933 .27 .74 |
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O1 .454 .355 0 1.1 |
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O2 .692 .881 0 .9 |
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O3 .3504 .950 .786 1.6 |
|
O4 .2684 .3726 .825 1.5 |
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Cl .5 .5 .5 .96 4.9 |
|
OH .5 .5 .5 .04 4.9 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 25 C (HRPXRD) |
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Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006232 |
|
12.06503 12.06503 7.58360 90 90 90 *P4_2/n |
|
.25 .25 .25 |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .6158 .5377 .7616 .31 .0306 .0243 .0258 .0417 .0163 .0042 -.0013 |
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Na .6158 .5377 .7616 .69 .0306 .0243 .0258 .0417 .0163 .0042 -.0013 |
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Si1 .5896 .6594 .2472 .0078 .0077 .0063 .0095 -.0008 .0001 -.0012 |
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Al2 .9103 .1653 .0482 .87 .0083 .0083 .0078 .0087 -.0024 -.0017 .0058 |
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Si2 .9103 .1653 .0482 .13 .0083 .0083 .0078 .0087 -.0024 -.0017 .0058 |
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Al3 .6636 .0857 .9600 .02 .0105 .0151 .0105 .0059 -.0005 .0014 .0031 |
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Si3 .6636 .0857 .9600 .98 .0105 .0151 .0105 .0059 -.0005 .0014 .0031 |
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O1 .7081 .6015 .2507 .015 .0164 .0164 .0121 .0014 .0036 .0153 |
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Cl .75 .75 .75 .76 .0664 .0754 .0754 .0484 0 0 0 |
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C .75 .75 .75 .24 .0664 .0754 .0754 .0484 0 0 0 |
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O2 .9430 .1281 .2639 .0203 .0298 .0209 .0101 .0085 -.0032 .0184 |
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O3 .6003 .1931 .0419 .0263 .0344 .0180 .0265 -.0172 .0032 -.0080 |
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O4 .7953 .0990 .9667 .0219 .0365 .0208 .0084 -.0151 -.0051 .0015 |
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O5 .5192 .6204 .0820 .0128 .0220 .0072 .0091 .0037 -.0320 .0003 |
|
O6 .6228 .9782 .0743 .0237 .0022 .0361 .0326 -.0039 .0016 -.0250 |
|
O7 .7645 .6405 .7387 .048 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 26 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006233 |
|
12.0652 12.0652 7.5827 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6162 .5383 .7542 .31 .040 |
|
Na .6162 .5383 .7542 .69 .040 |
|
Si1 .5905 .6608 .2609 .0191 |
|
Al2 .9076 .1677 .0494 .87 .0191 |
|
Si2 .9076 .1677 .0494 .13 .0191 |
|
Al3 .6644 .0861 .9605 .02 .0191 |
|
Si3 .6644 .0861 .9605 .98 .0191 |
|
O1 .7090 .6021 .2535 .028 |
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Cl .75 .75 .75 .76 .093 |
|
C .75 .75 .75 .24 .093 |
|
O2 .9450 .1281 .2582 .028 |
|
O3 .5949 .1896 .0348 .028 |
|
O4 .7992 .1010 .9672 .028 |
|
O5 .5121 .6155 .0900 .028 |
|
O6 .6281 .9729 .0616 .028 |
|
O7 .7702 .6480 .754 .093 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 105 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006234 |
|
12.0749 12.0749 7.5814 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6163 .5385 .7569 .31 .042 |
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Na .6163 .5385 .7569 .69 .042 |
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Si1 .5898 .6612 .2545 .0180 |
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Al2 .9093 .1675 .0506 .87 .0180 |
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Si2 .9093 .1675 .0506 .13 .0180 |
|
Al3 .6657 .0874 .9622 .02 .0180 |
|
Si3 .6657 .0874 .9622 .98 .0180 |
|
O1 .7093 .6029 .2533 .027 |
|
O2 .9448 .1293 .2702 .027 |
|
O3 .5935 .1870 .0360 .027 |
|
O4 .7973 .1033 .9689 .027 |
|
O5 .5162 .6162 .0877 .027 |
|
O6 .6291 .9756 .0639 .027 |
|
O7 .7899 .6507 .748 .090 |
|
C .75 .75 .75 .24 .090 |
|
Cl .75 .75 .75 .76 .090 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 204 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006235 |
|
12.0882 12.0882 7.5808 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6164 .5386 .7429 .31 .046 |
|
Na .6164 .5386 .7429 .69 .046 |
|
Si1 .5889 .6613 .2481 .0174 |
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Al2 .9095 .1677 .0484 .87 .0174 |
|
Si2 .9095 .1677 .0484 .13 .0174 |
|
Al3 .6661 .0869 .9602 .02 .0174 |
|
Si3 .6661 .0869 .9602 .98 .0174 |
|
O1 .7091 .6038 .2596 .026 |
|
O2 .9444 .1308 .2741 .026 |
|
O3 .5939 .1860 .0359 .026 |
|
O4 .7961 .1042 .9705 .026 |
|
O5 .5171 .6155 .0719 .026 |
|
O6 .6314 .9754 .0791 .026 |
|
O7 .8061 .6545 .748 .087 |
|
C .75 .75 .75 .24 .087 |
|
Cl .75 .75 .75 .76 .087 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 305 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006236 |
|
12.1025 12.1025 7.5804 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6170 .5394 .7435 .31 .052 |
|
Na .6170 .5394 .7435 .69 .052 |
|
Si1 .5883 .6615 .2452 .0186 |
|
Al2 .9096 .1678 .0501 .87 .0186 |
|
Si2 .9096 .1678 .0501 .13 .0186 |
|
Al3 .6666 .0872 .9610 .02 .0186 |
|
Si3 .6666 .0872 .9610 .98 .0186 |
|
O1 .7091 .6048 .2602 .026 |
|
O2 .9443 .1319 .2734 .026 |
|
O3 .5940 .1857 .0333 .026 |
|
O4 .7957 .1044 .9710 .026 |
|
O5 .5167 .6153 .0725 .026 |
|
O6 .6329 .9754 .0798 .026 |
|
O7 .8192 .6644 .746 .096 |
|
C .75 .75 .75 .24 .096 |
|
Cl .75 .75 .75 .76 .096 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 405 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006237 |
|
12.1172 12.1172 7.5800 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6174 .5403 .7502 .31 .058 |
|
Na .6174 .5403 .7502 .69 .058 |
|
Si1 .5881 .6616 .2428 .0198 |
|
Al2 .9095 .1677 .0534 .87 .0198 |
|
Si2 .9095 .1677 .0534 .13 .0198 |
|
Al3 .6670 .0873 .9627 .02 .0198 |
|
Si3 .6670 .0873 .9627 .98 .0198 |
|
O1 .7091 .6058 .2529 .029 |
|
O2 .9443 .1326 .2715 .029 |
|
O3 .5933 .1861 .0302 .029 |
|
O4 .7957 .1052 .9702 .029 |
|
O5 .5152 .6162 .0776 .029 |
|
O6 .6341 .9747 .0771 .029 |
|
O7 .8265 .6703 .749 .103 |
|
C .75 .75 .75 .24 .103 |
|
Cl .75 .75 .75 .76 .103 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 505 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006238 |
|
12.1335 12.1335 7.5801 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6176 .5410 .7538 .31 .062 |
|
Na .6176 .5410 .7538 .69 .062 |
|
Si1 .5882 .6620 .2427 .0219 |
|
Al2 .9098 .1676 .0541 .87 .0219 |
|
Si2 .9098 .1676 .0541 .13 .0219 |
|
Al3 .6677 .0871 .9625 .02 .0219 |
|
Si3 .6677 .0871 .9625 .98 .0219 |
|
O1 .7092 .6061 .2449 .033 |
|
O2 .9441 .1333 .2715 .033 |
|
O3 .5924 .1870 .0295 .033 |
|
O4 .7966 .1064 .9705 .033 |
|
O5 .5143 .6181 .0794 .033 |
|
O6 .6338 .9744 .0772 .033 |
|
O7 .8266 .6703 .749 .108 |
|
C .75 .75 .75 .24 .108 |
|
Cl .75 .75 .75 .76 .108 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 603 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006239 |
|
12.1510 12.1510 7.5800 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6177 .5417 .7549 .31 .070 |
|
Na .6177 .5417 .7549 .69 .070 |
|
Si1 .5880 .6623 .2447 .0247 |
|
Al2 .9101 .1678 .0549 .87 .0247 |
|
Si2 .9101 .1678 .0549 .13 .0247 |
|
Al3 .6685 .0874 .9620 .02 .0247 |
|
Si3 .6685 .0874 .9620 .98 .0247 |
|
O1 .7091 .6068 .2429 .037 |
|
O2 .9443 .1343 .2725 .037 |
|
O3 .5927 .1876 .0288 .037 |
|
O4 .7969 .1070 .9725 .037 |
|
O5 .5146 .6196 .0806 .037 |
|
O6 .6341 .9751 .0770 .037 |
|
O7 .8294 .6726 .749 .117 |
|
C .75 .75 .75 .24 .117 |
|
Cl .75 .75 .75 .76 .117 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 702 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006240 |
|
12.1673 12.1673 7.5799 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6178 .5425 .7548 .31 .077 |
|
Na .6178 .5425 .7548 .69 .077 |
|
Si1 .5876 .6624 .2498 .0267 |
|
Al2 .9105 .1681 .0556 .87 .0267 |
|
Si2 .9105 .1681 .0556 .13 .0267 |
|
Al3 .6690 .0882 .9617 .02 .0267 |
|
Si3 .6690 .0882 .9617 .98 .0267 |
|
O1 .7088 .6080 .2454 .040 |
|
O2 .9440 .1354 .2724 .040 |
|
O3 .5930 .1875 .0274 .040 |
|
O4 .7971 .1065 .9740 .040 |
|
O5 .5154 .6202 .0841 .040 |
|
O6 .6348 .9772 .0758 .040 |
|
O7 .8407 .6896 .753 .130 |
|
C .75 .75 .75 .24 .130 |
|
Cl .75 .75 .75 .76 .130 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Marialite |
|
Antao S M, Hassan I |
|
The Canadian Mineralogist 46 (2008) 1577-1591 |
|
Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
|
Locality: Monmouth Township, Ontario, Canada |
|
Note: T = 801 C |
|
Note: 32.9% Meionite, 67.1% Marialite |
|
_database_code_amcsd 0006241 |
|
12.1844 12.1844 7.5799 90 90 90 *P4_2/n |
|
.25 .25 .25 |
|
atom x y z occ Uiso |
|
Ca .6176 .5426 .7557 .31 .084 |
|
Na .6176 .5426 .7557 .69 .084 |
|
Si1 .5874 .6633 .2547 .0291 |
|
Al2 .9110 .1690 .0551 .87 .0291 |
|
Si2 .9110 .1690 .0551 .13 .0291 |
|
Al3 .6696 .0886 .9603 .02 .0291 |
|
Si3 .6696 .0886 .9603 .98 .0291 |
|
O1 .7079 .6081 .2478 .044 |
|
O2 .9444 .1365 .2695 .044 |
|
O3 .5938 .1868 .0258 .044 |
|
O4 .7978 .1068 .9744 .044 |
|
O5 .5186 .6217 .0866 .044 |
|
O6 .6361 .9802 .0750 .044 |
|
O7 .8407 .6904 .752 .141 |
|
C .75 .75 .75 .24 .141 |
|
Cl .75 .75 .75 .76 .141 |
|
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
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Marialite |
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Antao S M, Hassan I |
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The Canadian Mineralogist 46 (2008) 1577-1591 |
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Increase in Al-Si and Na-Ca disorder with temperature in scapolite Me32.9 |
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Locality: Monmouth Township, Ontario, Canada |
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Note: T = 902 C |
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Note: 32.9% Meionite, 67.1% Marialite |
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_database_code_amcsd 0006242 |
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12.1974 12.1974 7.5795 90 90 90 *P4_2/n |
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.25 .25 .25 |
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atom x y z occ Uiso |
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Ca .6153 .5409 .7477 .31 .082 |
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Na .6153 .5409 .7477 .69 .082 |
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Si1 .5904 .6646 .2539 .0322 |
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Al2 .9111 .1699 .0574 .55 .0322 |
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Si2 .9111 .1699 .0574 .45 .0322 |
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Al3 .6700 .0859 .9626 .57 .0322 |
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Si3 .6700 .0859 .9626 .43 .0322 |
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O1 .7056 .6005 .2479 .046 |
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O2 .9525 .1340 .2622 .046 |
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O3 .5969 .1945 .0285 .046 |
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O4 .8059 .1152 .9772 .046 |
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O5 .5055 .6221 .1080 .046 |
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O6 .6381 .9637 .0638 .046 |
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O7 .7758 .6539 .8305 .162 |
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C .75 .75 .75 .24 .162 |
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Cl .75 .75 .75 .76 .162 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
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Marialite |
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Antao S M, Hassan I |
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The Canadian Mineralogist 49 (2011) 581-586 |
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Complete Al-Si order in scapolite Me37.5, ideally Ca3Na5[Al8Si16O48]Cl(CO3), |
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and implications for antiphase domain boundaries (APBs) |
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Locality: Lake Clear, Ontario, Canada |
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_database_code_amcsd 0018479 |
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12.07899 12.07899 7.583467 90 90 90 *P4_2/n |
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.25 .25 .25 |
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atom x y z occ Uiso |
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ClA .75 .75 .75 .550 .0571 |
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SA .75 .75 .75 .040 .0571 |
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CA .75 .75 .75 .409 .0571 |
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FeM .61414 .53529 .7632 .003 .0201 |
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SrM .61414 .53529 .7632 .004 .0201 |
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CaM .61414 .53529 .7632 .338 .0201 |
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NaM .61414 .53529 .7632 .547 .0201 |
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KM .61414 .53529 .7632 .040 .0201 |
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Si1 .58983 .65957 .2485 .0077 |
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Al2 .9101 .1659 .0494 .0089 |
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Si3 .66266 .0855 .9616 .0089 |
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O1 .7085 .5997 .2516 .0178 |
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O2 .9437 .1251 .2641 .0178 |
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O3 .6013 .1901 .0431 .0221 |
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O4 .7945 .0989 .9658 .0182 |
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O5 .5202 .6174 .0785 .0209 |
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O6 .6245 .9784 .0725 .0234 |
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O7C .8452 .7950 .8002 .347 .0571 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
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